4-[(3-azanyl-4-chloranyl-phenyl)carbonylamino]-3-chloranyl-benzenesulfonic acid

Systemtic Name: 4-[(3-azanyl-4-chloranyl-phenyl)carbonylamino]-3-chloranyl-benzenesulfonic acid Openeye Name: 4-[(3-amino-4-chloro-benzoyl)amino]-3-chloro-benzenesulfonic acid CAS Name: 4-[[(3-amino-4-chlorophenyl)-oxomethyl]amino]-3-chlorobenzenesulfonic acid IUPAC Name: 4-[(3-amino-4-chlorobenzoyl)amino]-3-chlorobenzenesulfonic acid Traditional Name: 4-[(3-amino-4-chloro-benzoyl)amino]-3-chloro-besylic acid Formula: C13H10Cl2N2O4S MolecularWeight: 361.2005

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)NC2=C(C=C(C=C2)S(=O)(=O)O)Cl)N)Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)NC2=C(C=C(C=C2)S(=O)(=O)O)Cl)N)Cl

InChI

InChI=1S/C13H10Cl2N2O4S/c14-9-3-1-7(5-11(9)16)13(18)17-12-4-2-8(6-10(12)15)22(19,20)21/h1-6H,16H2,(H,17,18)(H,19,20,21)